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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02817334

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ADI2',3'-DIDEOXYADENOSINE-5'-DIPHOSPHATEA1JX40.72
HA8N6-(buta-2,3-dienyl)adenineA3C0P0.74
103A,B,C1CUL0.73
L213-(3-methylbut-2-en-1-yl)-3H-purin-
6-amine		A,B2W6Z0.75
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA8ICU0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C1CJV0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,P,T1ZYQ0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA1KEJ0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,P1SKR0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C1CJT0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C,P,Q1SL00.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEP2IMW0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,C1CJU0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,T2BQU0.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,P,T1SL20.72
DAD2',3'-DIDEOXYADENOSINE-5'-TRIPHOSPHATEA,B1QSY0.72
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,D,E,H,J3GIJ0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1T7P0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,X2PYL0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P1SKR0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL10.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1SL20.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1TK80.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B,H,P1R0A0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,B1QSY0.73
2DA2',3'-DIDEOXYADENOSINE-5'-MONOPHOSPHATEA,P,T1MQ20.73
IHE6-(CYCLOHEXYLAMINO)-9-[2-(4-METHYLPIPERAZIN-
1-YL)-ETHYL]-9H-PURINE-2-CARBONITRILE		A1U9V0.7
RMP2'-DEOXY-ADENOSINE-5'-RP-MONOMETHYLPHOSPHONATEB1K1R0.7
RMP2'-DEOXY-ADENOSINE-5'-RP-MONOMETHYLPHOSPHONATEB1K1H0.7
XAL[(1S,4R,6R)-6-HYDROXY-4-(ADENIN-
9-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE		A,B2H0N0.81
101A,B,C1CS40.7
A43A,B,C,D,E,F363D0.72
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LVU0.76
9PP2,6-DIAMINO-(S)-9-[2-(PHOSPHONOMETHOXY)PROPYL]PURINEA,B,C,D,E,F1LV80.76
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE		A1W1Q0.74
ZIPN-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN-
6-AMINE		A2EXM0.74
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B1ZOT0.77
EMA(ADENIN-9-YL-ETHOXYMETHYL)-HYDROXYPHOSPHINYL-
DIPHOSPHATE		A,B,C,D,E,F1PK00.77
APS9-HYDROXYPROPYLADENINE, S-ISOMERA,B1E2I0.72
SDG2-amino-9-(2-deoxy-5-O-phosphono-
beta-D-erythro-pentofuranosyl)-
9H-purine-6-selenol		A,C2R7Y0.7
5HG{[2-(6-AMINO-9H-PURIN-9-YL)ETHOXY]METHYL}PHOSPHONIC ACIDA,B2G1A0.78
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B,C,D2FLH0.7
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B,C,D3C0V0.7
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A2QIM0.7
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B3D7W0.7
ZEA(2E)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A1W1R0.7
ARP9-HYDROXYPROPYLADENINE, R-ISOMERA,B1E2I0.72
39A6-AMINO-3,9-DIMETHYL-9H-PURIN-3-
IUM		A,B1PU70.73
ADZ9-METHYL-9H-PURIN-6-AMINEA1O9U0.72
FA25-(6-AMINO-9H-PURIN-9-YL)-4-HYDROXYTETRAHYDROFURAN-
3-YL DIHYDROGEN PHOSPHATE		A,B1PWF0.71
ZAD(S)-1'-(2',3'-DIHYDROXYPROPYL)-
ADENINE		A2JJA0.74
301N6-(penta-2,3-dienyl)adenineA3BW70.76
ZEZ(2Z)-2-methyl-4-(9H-purin-6-ylamino)but-
2-en-1-ol		A,B3D7W0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA1S1K0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,B1D760.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA,M1ZAY0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA211D0.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEC,E3C290.7
1AP2,6-DIAMINOPURINE NUCLEOTIDEA210D0.7
I172-[TRANS-(4-AMINOCYCLOHEXYL)AMINO]-
6-(BENZYL-AMINO)-9-CYCLOPENTYLPURINE		A1G5S0.7
M011-[1-(9H-purin-6-yl)piperidin-4-
yl]methanamine		A2VNW0.72
SMP2'-DEOXY-ADENOSINE-5'-SP-MONOMETHYLPHOSPHONATEB1K1H0.7
AD22'-DEOXY-ADENOSINE-3'-5'-DIPHOSPHATEA,C1L2B0.71
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA1EXL0.75
2AR2'-DEOXYARISTEROMYCIN-5'-PHOSPHATEA,B1FYI0.75
TFO[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYLPHOSPHONIC ACIDA,P1T030.77
XAR[(1R,4S,6S)-4-(6-AMINO-9H-PURIN-
9-YL)-6-HYDROXYCYCLOHEX-2-EN-1-
YL]METHYL DIHYDROGEN PHOSPHATE		A,B2P8D0.81
D5M2'-DEOXYADENOSINE-5'-MONOPHOSPHATEA2G8G0.7
D5M2'-DEOXYADENOSINE-5'-MONOPHOSPHATEA,B2IOC0.7
D5M2'-DEOXYADENOSINE-5'-MONOPHOSPHATEA,B,C,D2QRO0.7
D5M2'-DEOXYADENOSINE-5'-MONOPHOSPHATEA,B,C,D2D7G0.7
D5M2'-DEOXYADENOSINE-5'-MONOPHOSPHATEB1Z1C0.7
D5M2'-DEOXYADENOSINE-5'-MONOPHOSPHATEA,B2PAU0.7
TNV[2-(6-AMINO-9H-PURIN-9-YL)-1-METHYLETHOXY]METHYL-
TRIPHOSPHATE		A,B,P1T050.75
A3A2'DEOXY-ALPHA-ANOMERIC-ADENOSINE-
5'-PHOSPHATE		A1S750.7
A3A2'DEOXY-ALPHA-ANOMERIC-ADENOSINE-
5'-PHOSPHATE		A1S740.7
A3A2'DEOXY-ALPHA-ANOMERIC-ADENOSINE-
5'-PHOSPHATE		A1S0T0.7
24A{[(4-{[2-(4-AMINOCYCLOHEXYL)-9-
ETHYL-9H-PURIN-6-YL]AMINO}PHENYL)(HYDROXY)PHOSPHORYL]METHYL}PHOSPHONIC ACID		A,B2BDF0.73
PPZ2-(PYRIDO[1,2-E]PURIN-4-YL)AMINO-
ETHANOL		A,B1I5V0.71
ADC(1'R,2'S)-9-(2-HYDROXY-3'-KETO-
CYCLOPENTEN-1-YL)ADENINE		A,B1A7A0.79
M021-(9H-purin-6-yl)piperidin-4-amineA2VNY0.72